5-ethanoyl-4-(3-nitrophenyl)-6-(trifluoromethyl)-3,4-dihydro-1H-pyrimidin-2-one

Systemtic Name: 5-ethanoyl-4-(3-nitrophenyl)-6-(trifluoromethyl)-3,4-dihydro-1H-pyrimidin-2-one Openeye Name: 5-acetyl-4-(3-nitrophenyl)-6-(trifluoromethyl)-3,4-dihydro-1H-pyrimidin-2-one CAS Name: 5-acetyl-4-(3-nitrophenyl)-6-(trifluoromethyl)-3,4-dihydro-1H-pyrimidin-2-one IUPAC Name: 5-acetyl-4-(3-nitrophenyl)-6-(trifluoromethyl)-3,4-dihydro-1H-pyrimidin-2-one Traditional Name: 5-acetyl-4-(3-nitrophenyl)-6-(trifluoromethyl)-3,4-dihydro-1H-pyrimidin-2-one Formula: C13H10F3N3O4 MolecularWeight: 329.23141

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(NC(=O)NC1C2=CC(=CC=C2)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CC(=O)C1=C(NC(=O)NC1C2=CC(=CC=C2)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C13H10F3N3O4/c1-6(20)9-10(7-3-2-4-8(5-7)19(22)23)17-12(21)18-11(9)13(14,15)16/h2-5,10H,1H3,(H2,17,18,21)